N-[10,10-bis(oxidanylidene)phenoxathiin-2-yl]-3-nitro-benzenesulfonamide

Systemtic Name: N-[10,10-bis(oxidanylidene)phenoxathiin-2-yl]-3-nitro-benzenesulfonamide Openeye Name: N-(10,10-dioxophenoxathiin-2-yl)-3-nitro-benzenesulfonamide CAS Name: N-(10,10-dioxo-2-phenoxathiinyl)-3-nitrobenzenesulfonamide IUPAC Name: N-(10,10-dioxophenoxathiin-2-yl)-3-nitrobenzenesulfonamide Traditional Name: N-(10,10-diketophenoxathiin-2-yl)-3-nitro-benzenesulfonamide Formula: C18H12N2O7S2 MolecularWeight: 432.42708

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)OC3=C(S2(=O)=O)C=C(C=C3)NS(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)OC3=C(S2(=O)=O)C=C(C=C3)NS(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C18H12N2O7S2/c21-20(22)13-4-3-5-14(11-13)29(25,26)19-12-8-9-16-18(10-12)28(23,24)17-7-2-1-6-15(17)27-16/h1-11,19H